1-[bis(4-phenylphenyl)methyl]-4-phenylbenzene;pentachloro-λ5-stibane;chloride

C37H27Cl6Sb — CID 159045848

IUPAC1-[bis(4-phenylphenyl)methyl]-4-phenylbenzene;pentachloro-λ5-stibane;chloride
SMILESCl[Sb](Cl)(Cl)(Cl)Cl.[Cl-].c1ccc(-c2ccc([C+](c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C37H27.6ClH.Sb/c1-4-10-28(11-5-1)31-16-22-34(23-17-31)37(35-24-18-32(19-25-35)29-12-6-2-7-13-29)36-26-20-33(21-27-36)30-14-8-3-9-15-30;;;;;;;/h1-27H;6*1H;/q+1;;;;;;;+5/p-6
InChIKeyVUAMXGXEALVIKG-UHFFFAOYSA-H
MW806.10 g/mol
LogP9.78
Rot. Bonds6

About 1-[bis(4-phenylphenyl)methyl]-4-phenylbenzene;pentachloro-λ5-stibane;chloride

1-[bis(4-phenylphenyl)methyl]-4-phenylbenzene;pentachloro-λ5-stibane;chloride (PubChem CID 159045848) has the molecular formula C37H27Cl6Sb and a molecular weight of 806.10 g/mol. Its IUPAC name is 1-[bis(4-phenylphenyl)methyl]-4-phenylbenzene;pentachloro-λ5-stibane;chloride.

Molecular Properties

Compound Name1-[bis(4-phenylphenyl)methyl]-4-phenylbenzene;pentachloro-λ5-stibane;chloride
PubChem CID159045848
Molecular FormulaC37H27Cl6Sb
Molecular Weight806.10 g/mol
Exact Mass801.93
IUPAC Name1-[bis(4-phenylphenyl)methyl]-4-phenylbenzene;pentachloro-λ5-stibane;chloride
SMILESCl[Sb](Cl)(Cl)(Cl)Cl.[Cl-].c1ccc(-c2ccc([C+](c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C37H27.6ClH.Sb/c1-4-10-28(11-5-1)31-16-22-34(23-17-31)37(35-24-18-32(19-25-35)29-12-6-2-7-13-29)36-26-20-33(21-27-36)30-14-8-3-9-15-30;;;;;;;/h1-27H;6*1H;/q+1;;;;;;;+5/p-6
InChIKeyVUAMXGXEALVIKG-UHFFFAOYSA-H
XLogP9.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500806.10
LogP ≤ 59.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze 1-[bis(4-phenylphenyl)methyl]-4-phenylbenzene;pentachloro-λ5-stibane;chloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[bis(4-phenylphenyl)methyl]-4-phenylbenzene;pentachloro-λ5-stibane;chloride?
The IUPAC name of 1-[bis(4-phenylphenyl)methyl]-4-phenylbenzene;pentachloro-λ5-stibane;chloride (CID 159045848) is 1-[bis(4-phenylphenyl)methyl]-4-phenylbenzene;pentachloro-λ5-stibane;chloride.
What is the SMILES notation for 1-[bis(4-phenylphenyl)methyl]-4-phenylbenzene;pentachloro-λ5-stibane;chloride?
The canonical SMILES for 1-[bis(4-phenylphenyl)methyl]-4-phenylbenzene;pentachloro-λ5-stibane;chloride is Cl[Sb](Cl)(Cl)(Cl)Cl.[Cl-].c1ccc(-c2ccc([C+](c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)cc2)cc1.
What is the InChIKey of 1-[bis(4-phenylphenyl)methyl]-4-phenylbenzene;pentachloro-λ5-stibane;chloride?
The InChIKey is VUAMXGXEALVIKG-UHFFFAOYSA-H. The full InChI is InChI=1S/C37H27.6ClH.Sb/c1-4-10-28(11-5-1)31-16-22-34(23-17-31)37(35-24-18-32(19-25-35)29-12-6-2-7-13-29)36-26-20-33(21-27-36)30-14-8-3-9-15-30;;;;;;;/h1-27H;6*1H;/q+1;;;;;;;+5/p-6.
What are the key properties of 1-[bis(4-phenylphenyl)methyl]-4-phenylbenzene;pentachloro-λ5-stibane;chloride?
1-[bis(4-phenylphenyl)methyl]-4-phenylbenzene;pentachloro-λ5-stibane;chloride has a molecular weight of 806.10 g/mol, XLogP of 9.78, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[bis(4-phenylphenyl)methyl]-4-phenylbenzene;pentachloro-λ5-stibane;chloride is sourced from PubChem (CID 159045848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).